41Y
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C19 | C17 | sing | 1.53Å | 1.53Å | |
| C18 | C17 | sing | 1.53Å | 1.53Å | |
| C17 | C16 | sing | 1.51Å | 1.53Å | |
| C15 | C16 | doub | 1.38Å | 1.40Å | Aromatic |
| C15 | C14 | sing | 1.38Å | 1.39Å | Aromatic |
| C16 | C20 | sing | 1.38Å | 1.39Å | Aromatic |
| C14 | C13 | doub | 1.38Å | 1.39Å | Aromatic |
| C20 | C21 | doub | 1.38Å | 1.39Å | Aromatic |
| C13 | C21 | sing | 1.38Å | 1.39Å | Aromatic |
| C13 | C11 | sing | 1.51Å | 1.58Å | |
| C12 | C11 | sing | 1.53Å | 1.59Å | |
| C11 | N10 | sing | 1.47Å | 1.34Å | |
| C23 | C22 | sing | 1.53Å | 1.60Å | |
| N10 | C22 | sing | 1.47Å | 1.39Å | |
| N10 | C09 | sing | 1.47Å | 1.40Å | |
| C22 | C06 | sing | 1.51Å | 1.52Å | |
| C09 | C08 | sing | 1.53Å | 1.59Å | |
| C06 | C05 | doub | 1.39Å | 1.44Å | Aromatic |
| C06 | C07 | sing | 1.38Å | 1.31Å | Aromatic |
| C05 | C04 | sing | 1.38Å | 1.38Å | Aromatic |
| C08 | C07 | sing | 1.51Å | 1.56Å | |
| C07 | C24 | doub | 1.40Å | 1.45Å | Aromatic |
| C04 | C03 | doub | 1.39Å | 1.38Å | Aromatic |
| C24 | C03 | sing | 1.40Å | 1.39Å | Aromatic |
| C24 | C25 | sing | 1.48Å | 1.38Å | |
| C03 | O02 | sing | 1.36Å | 1.40Å | |
| C25 | C26 | doub | 1.39Å | 1.39Å | Aromatic |
| C25 | C37 | sing | 1.39Å | 1.40Å | Aromatic |
| O02 | C01 | sing | 1.43Å | 1.41Å | |
| C26 | C27 | sing | 1.38Å | 1.38Å | Aromatic |
| C37 | C31 | doub | 1.39Å | 1.40Å | Aromatic |
| C27 | F28 | sing | 1.35Å | 1.36Å | |
| C27 | C29 | doub | 1.39Å | 1.39Å | Aromatic |
| C31 | C29 | sing | 1.39Å | 1.39Å | Aromatic |
| C31 | N32 | sing | 1.40Å | 1.46Å | |
| C29 | O30 | sing | 1.36Å | 1.40Å | |
| N32 | C33 | sing | 1.46Å | 1.45Å | |
| C35 | C34 | sing | 1.53Å | 1.53Å | |
| C33 | C34 | sing | 1.53Å | 1.53Å | |
| C34 | C36 | sing | 1.53Å | 1.53Å | |
| C11 | H1 | sing | 1.09Å | 1.10Å | |
| C12 | H2 | sing | 1.09Å | 1.10Å | |
| C12 | H3 | sing | 1.09Å | 1.10Å | |
| C12 | H4 | sing | 1.09Å | 1.10Å | |
| C14 | H5 | sing | 1.08Å | 1.08Å | |
| C15 | H6 | sing | 1.08Å | 1.08Å | |
| C01 | H7 | sing | 1.09Å | 1.10Å | |
| C01 | H8 | sing | 1.09Å | 1.10Å | |
| C01 | H9 | sing | 1.09Å | 1.10Å | |
| C04 | H10 | sing | 1.08Å | 1.08Å | |
| C05 | H11 | sing | 1.08Å | 1.08Å | |
| C08 | H12 | sing | 1.09Å | 1.10Å | |
| C08 | H13 | sing | 1.09Å | 1.10Å | |
| C09 | H14 | sing | 1.09Å | 1.10Å | |
| C09 | H15 | sing | 1.09Å | 1.10Å | |
| C17 | H17 | sing | 1.09Å | 1.10Å | |
| C18 | H18 | sing | 1.09Å | 1.10Å | |
| C18 | H19 | sing | 1.09Å | 1.10Å | |
| C18 | H20 | sing | 1.09Å | 1.10Å | |
| C19 | H21 | sing | 1.09Å | 1.10Å | |
| C19 | H22 | sing | 1.09Å | 1.10Å | |
| C19 | H23 | sing | 1.09Å | 1.10Å | |
| C20 | H24 | sing | 1.08Å | 1.08Å | |
| C21 | H25 | sing | 1.08Å | 1.08Å | |
| C22 | H26 | sing | 1.09Å | 1.10Å | |
| C23 | H27 | sing | 1.09Å | 1.10Å | |
| C23 | H28 | sing | 1.09Å | 1.10Å | |
| C23 | H29 | sing | 1.09Å | 1.10Å | |
| C26 | H30 | sing | 1.08Å | 1.08Å | |
| O30 | H31 | sing | 0.97Å | 0.95Å | |
| N32 | H32 | sing | 0.97Å | 1.00Å | |
| C33 | H33 | sing | 1.09Å | 1.10Å | |
| C33 | H34 | sing | 1.09Å | 1.10Å | |
| C34 | H35 | sing | 1.09Å | 1.10Å | |
| C35 | H36 | sing | 1.09Å | 1.10Å | |
| C35 | H37 | sing | 1.09Å | 1.10Å | |
| C35 | H38 | sing | 1.09Å | 1.10Å | |
| C36 | H39 | sing | 1.09Å | 1.10Å | |
| C36 | H40 | sing | 1.09Å | 1.10Å | |
| C36 | H41 | sing | 1.09Å | 1.10Å | |
| C37 | H42 | sing | 1.08Å | 1.08Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C19 | C17 | C18 | 111.9° | 109.4° |
| C19 | C17 | C16 | 110.4° | 109.5° |
| C19 | C17 | H17 | 107.4° | 109.5° |
| C17 | C19 | H21 | 109.5° | 109.4° |
| C17 | C19 | H22 | 109.5° | 109.5° |
| C17 | C19 | H23 | 109.5° | 109.5° |
| C18 | C17 | C16 | 111.9° | 109.5° |
| C18 | C17 | H17 | 107.5° | 109.4° |
| C17 | C18 | H18 | 109.5° | 109.5° |
| C17 | C18 | H19 | 109.4° | 109.5° |
| C17 | C18 | H20 | 109.5° | 109.5° |
| C17 | C16 | C15 | 120.9° | 120.0° |
| C17 | C16 | C20 | 119.3° | 120.0° |
| C16 | C17 | H17 | 107.5° | 109.5° |
| C16 | C15 | C14 | 119.9° | 120.0° |
| C15 | C16 | C20 | 119.8° | 120.0° |
| C16 | C15 | H6 | 120.1° | 120.0° |
| C15 | C14 | C13 | 119.7° | 120.0° |
| C15 | C14 | H5 | 120.2° | 120.0° |
| C14 | C15 | H6 | 120.1° | 120.0° |
| C16 | C20 | C21 | 120.3° | 120.0° |
| C16 | C20 | H24 | 119.9° | 120.0° |
| C14 | C13 | C21 | 120.4° | 120.0° |
| C14 | C13 | C11 | 120.8° | 120.0° |
| C13 | C14 | H5 | 120.1° | 120.0° |
| C20 | C21 | C13 | 119.9° | 120.0° |
| C21 | C20 | H24 | 119.8° | 120.0° |
| C20 | C21 | H25 | 120.0° | 120.1° |
| C21 | C13 | C11 | 118.8° | 120.0° |
| C13 | C21 | H25 | 120.1° | 119.9° |
| C13 | C11 | C12 | 103.9° | 109.4° |
| C13 | C11 | N10 | 108.7° | 109.5° |
| C13 | C11 | H1 | 107.8° | 109.5° |
| C12 | C11 | N10 | 117.1° | 109.4° |
| C12 | C11 | H1 | 107.6° | 109.5° |
| C11 | C12 | H2 | 109.5° | 109.4° |
| C11 | C12 | H3 | 109.5° | 109.5° |
| C11 | C12 | H4 | 109.5° | 109.4° |
| C11 | N10 | C22 | 113.3° | 111.0° |
| C11 | N10 | C09 | 116.5° | 111.0° |
| N10 | C11 | H1 | 111.1° | 109.4° |
| C23 | C22 | N10 | 110.2° | 109.2° |
| C23 | C22 | C06 | 106.0° | 109.3° |
| C23 | C22 | H26 | 107.2° | 109.2° |
| C22 | C23 | H27 | 109.5° | 109.4° |
| C22 | C23 | H28 | 109.5° | 109.4° |
| C22 | C23 | H29 | 109.5° | 109.5° |
| C22 | N10 | C09 | 116.1° | 110.3° |
| N10 | C22 | C06 | 115.0° | 110.5° |
| N10 | C22 | H26 | 109.9° | 109.3° |
| N10 | C09 | C08 | 116.1° | 108.5° |
| N10 | C09 | H14 | 107.8° | 109.6° |
| N10 | C09 | H15 | 107.8° | 109.8° |
| C22 | C06 | C05 | 119.4° | 118.3° |
| C22 | C06 | C07 | 120.2° | 121.8° |
| C06 | C22 | H26 | 108.2° | 109.3° |
| C09 | C08 | C07 | 114.4° | 110.0° |
| C09 | C08 | H12 | 108.2° | 109.4° |
| C09 | C08 | H13 | 108.2° | 109.3° |
| C08 | C09 | H14 | 107.8° | 109.7° |
| C08 | C09 | H15 | 107.8° | 109.6° |
| C05 | C06 | C07 | 120.3° | 119.9° |
| C06 | C05 | C04 | 119.7° | 120.7° |
| C06 | C05 | H11 | 120.2° | 119.7° |
| C06 | C07 | C08 | 119.4° | 121.7° |
| C06 | C07 | C24 | 120.2° | 119.8° |
| C05 | C04 | C03 | 120.5° | 119.9° |
| C05 | C04 | H10 | 119.7° | 120.0° |
| C04 | C05 | H11 | 120.1° | 119.6° |
| C08 | C07 | C24 | 120.3° | 118.5° |
| C07 | C08 | H12 | 108.3° | 109.3° |
| C07 | C08 | H13 | 108.2° | 109.4° |
| C07 | C24 | C03 | 119.7° | 120.1° |
| C07 | C24 | C25 | 119.9° | 120.0° |
| C04 | C03 | C24 | 119.5° | 119.6° |
| C04 | C03 | O02 | 120.0° | 120.2° |
| C03 | C04 | H10 | 119.8° | 120.0° |
| C03 | C24 | C25 | 120.3° | 119.9° |
| C24 | C03 | O02 | 120.4° | 120.2° |
| C24 | C25 | C26 | 115.4° | 120.0° |
| C24 | C25 | C37 | 124.3° | 120.0° |
| C03 | O02 | C01 | 115.0° | 117.0° |
| C26 | C25 | C37 | 120.3° | 119.9° |
| C25 | C26 | C27 | 120.4° | 120.0° |
| C25 | C26 | H30 | 119.8° | 120.0° |
| C25 | C37 | C31 | 119.2° | 119.9° |
| C25 | C37 | H42 | 120.4° | 120.1° |
| O02 | C01 | H7 | 109.5° | 109.5° |
| O02 | C01 | H8 | 109.4° | 109.5° |
| O02 | C01 | H9 | 109.4° | 109.5° |
| C26 | C27 | F28 | 119.2° | 120.0° |
| C26 | C27 | C29 | 119.9° | 120.1° |
| C27 | C26 | H30 | 119.8° | 120.0° |
| C37 | C31 | C29 | 120.0° | 119.9° |
| C37 | C31 | N32 | 120.5° | 120.0° |
| C31 | C37 | H42 | 120.4° | 120.0° |
| F28 | C27 | C29 | 120.9° | 119.9° |
| C27 | C29 | C31 | 120.2° | 120.1° |
| C27 | C29 | O30 | 119.3° | 120.0° |
| C29 | C31 | N32 | 119.4° | 120.0° |
| C31 | C29 | O30 | 120.5° | 120.0° |
| C31 | N32 | C33 | 121.6° | 120.0° |
| C31 | N32 | H32 | 106.4° | 120.0° |
| C29 | O30 | H31 | 109.5° | 114.0° |
| N32 | C33 | C34 | 109.7° | 109.5° |
| C33 | N32 | H32 | 106.4° | 120.0° |
| N32 | C33 | H33 | 109.4° | 109.5° |
| N32 | C33 | H34 | 109.4° | 109.5° |
| C35 | C34 | C33 | 111.3° | 109.5° |
| C35 | C34 | C36 | 110.5° | 109.5° |
| C35 | C34 | H35 | 107.9° | 109.5° |
| C34 | C35 | H36 | 109.5° | 109.5° |
| C34 | C35 | H37 | 109.5° | 109.5° |
| C34 | C35 | H38 | 109.5° | 109.5° |
| C33 | C34 | C36 | 111.3° | 109.5° |
| C34 | C33 | H33 | 109.4° | 109.5° |
| C34 | C33 | H34 | 109.4° | 109.5° |
| C33 | C34 | H35 | 107.8° | 109.5° |
| C36 | C34 | H35 | 107.9° | 109.5° |
| C34 | C36 | H39 | 109.5° | 109.4° |
| C34 | C36 | H40 | 109.5° | 109.5° |
| C34 | C36 | H41 | 109.5° | 109.5° |
| H2 | C12 | H3 | 109.4° | 109.5° |
| H2 | C12 | H4 | 109.4° | 109.5° |
| H3 | C12 | H4 | 109.5° | 109.5° |
| H7 | C01 | H8 | 109.5° | 109.5° |
| H7 | C01 | H9 | 109.5° | 109.5° |
| H8 | C01 | H9 | 109.5° | 109.5° |
| H12 | C08 | H13 | 109.4° | 109.4° |
| H14 | C09 | H15 | 109.5° | 109.7° |
| H18 | C18 | H19 | 109.5° | 109.4° |
| H18 | C18 | H20 | 109.5° | 109.5° |
| H19 | C18 | H20 | 109.5° | 109.5° |
| H21 | C19 | H22 | 109.5° | 109.5° |
| H21 | C19 | H23 | 109.4° | 109.5° |
| H22 | C19 | H23 | 109.5° | 109.5° |
| H27 | C23 | H28 | 109.5° | 109.5° |
| H27 | C23 | H29 | 109.4° | 109.5° |
| H28 | C23 | H29 | 109.4° | 109.5° |
| H33 | C33 | H34 | 109.5° | 109.4° |
| H36 | C35 | H37 | 109.5° | 109.5° |
| H36 | C35 | H38 | 109.4° | 109.5° |
| H37 | C35 | H38 | 109.5° | 109.5° |
| H39 | C36 | H40 | 109.5° | 109.5° |
| H39 | C36 | H41 | 109.4° | 109.5° |
| H40 | C36 | H41 | 109.5° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C19 | C17 | C18 | C16 | 124.5° | 120.0° |
| C19 | C17 | C18 | H17 | 117.7° | 120.0° |
| C19 | C17 | C16 | H17 | 116.9° | 120.0° |
| C19 | C17 | C16 | C15 | 66.4° | 120.1° |
| C19 | C17 | C16 | C20 | 113.2° | 60.0° |
| C19 | C17 | C18 | H18 | 180.0° | 60.0° |
| C19 | C17 | C18 | H19 | 60.0° | 180.0° |
| C19 | C17 | C18 | H20 | 60.0° | 60.0° |
| C17 | C19 | H21 | H22 | 120.0° | 120.0° |
| C17 | C19 | H21 | H23 | 120.0° | 120.0° |
| C17 | C19 | H22 | H23 | 120.0° | 120.0° |
| C18 | C17 | C16 | H17 | 117.7° | 120.0° |
| C18 | C17 | C16 | C15 | 58.9° | 120.0° |
| C18 | C17 | C16 | C20 | 121.5° | 59.9° |
| C17 | C18 | H18 | H19 | 120.0° | 120.0° |
| C17 | C18 | H18 | H20 | 120.0° | 120.0° |
| C17 | C18 | H19 | H20 | 120.0° | 120.0° |
| C18 | C17 | C19 | H21 | 180.0° | 180.0° |
| C18 | C17 | C19 | H22 | 60.0° | 60.0° |
| C18 | C17 | C19 | H23 | 60.0° | 60.0° |
| C17 | C16 | C15 | C20 | 179.6° | 179.9° |
| C17 | C16 | C15 | C14 | 179.9° | 180.0° |
| C17 | C16 | C20 | C21 | 179.9° | 180.0° |
| C17 | C16 | C15 | H6 | 0.1° | 0.1° |
| C16 | C17 | C18 | H18 | 55.5° | 180.0° |
| C16 | C17 | C18 | H19 | 64.5° | 60.1° |
| C16 | C17 | C18 | H20 | 175.5° | 60.0° |
| C16 | C17 | C19 | H21 | 54.7° | 60.0° |
| C16 | C17 | C19 | H22 | 174.7° | 180.0° |
| C16 | C17 | C19 | H23 | 65.3° | 60.0° |
| C17 | C16 | C20 | H24 | 0.1° | 0.0° |
| C16 | C15 | C14 | H6 | 180.0° | 180.0° |
| C16 | C15 | C14 | C13 | 0.2° | 0.0° |
| C15 | C16 | C20 | C21 | 0.3° | 0.1° |
| C16 | C15 | C14 | H5 | 179.8° | 179.9° |
| C15 | C16 | C17 | H17 | 176.7° | 0.0° |
| C15 | C16 | C20 | H24 | 179.7° | 180.0° |
| C14 | C15 | C16 | C20 | 0.3° | 0.1° |
| C15 | C14 | C13 | H5 | 180.0° | 179.9° |
| C15 | C14 | C13 | C21 | 0.7° | 0.1° |
| C15 | C14 | C13 | C11 | 179.2° | 179.8° |
| C16 | C20 | C21 | H24 | 180.0° | 179.9° |
| C16 | C20 | C21 | C13 | 0.2° | 0.1° |
| C20 | C16 | C15 | H6 | 179.7° | 180.0° |
| C20 | C16 | C17 | H17 | 3.7° | 179.9° |
| C16 | C20 | C21 | H25 | 179.8° | 179.8° |
| C14 | C13 | C21 | C20 | 0.7° | 0.0° |
| C14 | C13 | C21 | C11 | 178.5° | 179.7° |
| C14 | C13 | C11 | C12 | 110.3° | 73.6° |
| C14 | C13 | C11 | N10 | 124.3° | 46.3° |
| C14 | C13 | C11 | H1 | 3.8° | 166.3° |
| C13 | C14 | C15 | H6 | 179.8° | 179.9° |
| C14 | C13 | C21 | H25 | 179.3° | 179.7° |
| C20 | C21 | C13 | H25 | 180.0° | 179.8° |
| C20 | C21 | C13 | C11 | 179.2° | 179.7° |
| C21 | C13 | C11 | C12 | 68.2° | 106.7° |
| C21 | C13 | C11 | N10 | 57.2° | 133.3° |
| C21 | C13 | C11 | H1 | 177.7° | 13.3° |
| C21 | C13 | C14 | H5 | 179.3° | 180.0° |
| C13 | C21 | C20 | H24 | 179.8° | 180.0° |
| C13 | C11 | C12 | N10 | 119.9° | 120.0° |
| C13 | C11 | C12 | H1 | 114.2° | 120.1° |
| C13 | C11 | N10 | H1 | 118.5° | 120.0° |
| C13 | C11 | N10 | C22 | 84.6° | 55.4° |
| C13 | C11 | N10 | C09 | 136.9° | 178.4° |
| C13 | C11 | C12 | H2 | 180.0° | 172.9° |
| C13 | C11 | C12 | H3 | 60.0° | 67.1° |
| C13 | C11 | C12 | H4 | 60.0° | 52.9° |
| C11 | C13 | C14 | H5 | 0.8° | 0.4° |
| C11 | C13 | C21 | H25 | 0.8° | 0.1° |
| C12 | C11 | N10 | H1 | 124.2° | 120.0° |
| C12 | C11 | N10 | C22 | 158.1° | 175.3° |
| C12 | C11 | N10 | C09 | 19.6° | 61.6° |
| C11 | C12 | H2 | H3 | 120.0° | 120.0° |
| C11 | C12 | H2 | H4 | 120.0° | 119.9° |
| C11 | C12 | H3 | H4 | 120.0° | 120.0° |
| C11 | N10 | C22 | C23 | 71.5° | 55.8° |
| C11 | N10 | C22 | C09 | 138.7° | 123.4° |
| C11 | N10 | C22 | C06 | 168.8° | 176.0° |
| C11 | N10 | C09 | C08 | 174.3° | 165.4° |
| N10 | C11 | C12 | H2 | 60.1° | 67.1° |
| N10 | C11 | C12 | H3 | 59.9° | 52.9° |
| N10 | C11 | C12 | H4 | 179.9° | 172.9° |
| C11 | N10 | C09 | H14 | 64.8° | 74.9° |
| C11 | N10 | C09 | H15 | 53.3° | 45.7° |
| C11 | N10 | C22 | H26 | 46.5° | 63.7° |
| C23 | C22 | N10 | C06 | 119.7° | 120.2° |
| C23 | C22 | N10 | H26 | 117.9° | 119.5° |
| C23 | C22 | N10 | C09 | 67.3° | 67.7° |
| C23 | C22 | C06 | H26 | 114.7° | 119.5° |
| C23 | C22 | C06 | C05 | 90.4° | 77.2° |
| C23 | C22 | C06 | C07 | 87.8° | 102.5° |
| C22 | C23 | H27 | H28 | 120.0° | 119.9° |
| C22 | C23 | H27 | H29 | 120.0° | 120.0° |
| C22 | C23 | H28 | H29 | 120.0° | 120.0° |
| N10 | C22 | C06 | H26 | 123.3° | 120.3° |
| C22 | N10 | C09 | C08 | 36.8° | 71.2° |
| N10 | C22 | C06 | C05 | 147.5° | 162.6° |
| N10 | C22 | C06 | C07 | 34.2° | 17.8° |
| C22 | N10 | C11 | H1 | 33.9° | 64.7° |
| C22 | N10 | C09 | H14 | 157.8° | 48.5° |
| C22 | N10 | C09 | H15 | 84.1° | 169.1° |
| N10 | C22 | C23 | H27 | 180.0° | 59.4° |
| N10 | C22 | C23 | H28 | 60.0° | 179.3° |
| N10 | C22 | C23 | H29 | 60.0° | 60.6° |
| C09 | N10 | C22 | C06 | 52.4° | 52.6° |
| N10 | C09 | C08 | H14 | 120.9° | 119.7° |
| N10 | C09 | C08 | H15 | 120.9° | 119.9° |
| N10 | C09 | C08 | C07 | 4.4° | 50.4° |
| C09 | N10 | C11 | H1 | 104.6° | 58.4° |
| N10 | C09 | C08 | H12 | 116.4° | 170.5° |
| N10 | C09 | C08 | H13 | 125.1° | 69.7° |
| N10 | C09 | H14 | H15 | 117.0° | 120.6° |
| C09 | N10 | C22 | H26 | 174.8° | 172.8° |
| C22 | C06 | C05 | C07 | 178.2° | 179.7° |
| C22 | C06 | C05 | C04 | 179.1° | 179.5° |
| C22 | C06 | C07 | C08 | 1.2° | 0.8° |
| C22 | C06 | C07 | C24 | 178.3° | 179.1° |
| C22 | C06 | C05 | H11 | 0.9° | 0.5° |
| C06 | C22 | C23 | H27 | 55.0° | 179.6° |
| C06 | C22 | C23 | H28 | 65.1° | 59.7° |
| C06 | C22 | C23 | H29 | 175.0° | 60.4° |
| C09 | C08 | C07 | C06 | 12.9° | 17.2° |
| C09 | C08 | C07 | H12 | 120.7° | 120.1° |
| C09 | C08 | C07 | H13 | 120.7° | 120.1° |
| C09 | C08 | C07 | C24 | 167.5° | 162.8° |
| C09 | C08 | H12 | H13 | 117.7° | 119.7° |
| C08 | C09 | H14 | H15 | 117.0° | 120.4° |
| C06 | C05 | C04 | H11 | 180.0° | 179.9° |
| C05 | C06 | C07 | C08 | 179.5° | 179.5° |
| C05 | C06 | C07 | C24 | 0.1° | 0.5° |
| C06 | C05 | C04 | C03 | 0.2° | 0.0° |
| C06 | C05 | C04 | H10 | 179.8° | 179.9° |
| C05 | C06 | C22 | H26 | 24.3° | 42.2° |
| C07 | C06 | C05 | C04 | 0.9° | 0.2° |
| C06 | C07 | C08 | C24 | 179.6° | 180.0° |
| C06 | C07 | C24 | C03 | 1.3° | 0.7° |
| C06 | C07 | C24 | C25 | 177.8° | 179.8° |
| C07 | C06 | C05 | H11 | 179.1° | 179.8° |
| C06 | C07 | C08 | H12 | 133.6° | 137.3° |
| C06 | C07 | C08 | H13 | 107.8° | 102.9° |
| C07 | C06 | C22 | H26 | 157.5° | 138.1° |
| C05 | C04 | C03 | H10 | 180.0° | 179.9° |
| C05 | C04 | C03 | C24 | 1.2° | 0.2° |
| C05 | C04 | C03 | O02 | 179.5° | 179.9° |
| C08 | C07 | C24 | C03 | 179.1° | 179.3° |
| C08 | C07 | C24 | C25 | 2.6° | 0.2° |
| C07 | C08 | H12 | H13 | 117.7° | 119.8° |
| C07 | C08 | C09 | H14 | 125.3° | 69.2° |
| C07 | C08 | C09 | H15 | 116.5° | 170.3° |
| C07 | C24 | C03 | C04 | 2.0° | 0.5° |
| C07 | C24 | C03 | C25 | 176.5° | 179.4° |
| C07 | C24 | C03 | O02 | 179.7° | 179.8° |
| C07 | C24 | C25 | C26 | 82.7° | 65.0° |
| C07 | C24 | C25 | C37 | 96.9° | 115.2° |
| C24 | C07 | C08 | H12 | 46.8° | 42.7° |
| C24 | C07 | C08 | H13 | 71.8° | 77.1° |
| C04 | C03 | C24 | O02 | 178.3° | 179.7° |
| C04 | C03 | C24 | C25 | 178.4° | 180.0° |
| C04 | C03 | O02 | C01 | 54.0° | 0.0° |
| C03 | C04 | C05 | H11 | 179.8° | 180.0° |
| C03 | C24 | C25 | C26 | 93.7° | 115.6° |
| C03 | C24 | C25 | C37 | 86.6° | 64.2° |
| C24 | C03 | O02 | C01 | 124.4° | 179.7° |
| C24 | C03 | C04 | H10 | 178.8° | 179.9° |
| C25 | C24 | C03 | O02 | 3.2° | 0.3° |
| C24 | C25 | C26 | C37 | 179.6° | 179.8° |
| C24 | C25 | C26 | C27 | 180.0° | 180.0° |
| C24 | C25 | C37 | C31 | 179.8° | 179.7° |
| C24 | C25 | C26 | H30 | 0.1° | 0.0° |
| C24 | C25 | C37 | H42 | 0.2° | 0.1° |
| C03 | O02 | C01 | H7 | 180.0° | 60.0° |
| C03 | O02 | C01 | H8 | 60.0° | 60.0° |
| C03 | O02 | C01 | H9 | 60.0° | 180.0° |
| O02 | C03 | C04 | H10 | 0.5° | 0.2° |
| C25 | C26 | C27 | H30 | 180.0° | 180.0° |
| C26 | C25 | C37 | C31 | 0.6° | 0.5° |
| C25 | C26 | C27 | F28 | 179.8° | 180.0° |
| C25 | C26 | C27 | C29 | 0.2° | 0.0° |
| C26 | C25 | C37 | H42 | 179.4° | 179.7° |
| C37 | C25 | C26 | C27 | 0.4° | 0.2° |
| C25 | C37 | C31 | H42 | 180.0° | 179.8° |
| C25 | C37 | C31 | C29 | 0.5° | 0.5° |
| C25 | C37 | C31 | N32 | 179.6° | 179.7° |
| C37 | C25 | C26 | H30 | 179.6° | 179.8° |
| O02 | C01 | H7 | H8 | 120.0° | 120.0° |
| O02 | C01 | H7 | H9 | 120.0° | 120.0° |
| O02 | C01 | H8 | H9 | 120.0° | 120.0° |
| C26 | C27 | F28 | C29 | 180.0° | 179.9° |
| C26 | C27 | C29 | C31 | 0.2° | 0.0° |
| C26 | C27 | C29 | O30 | 180.0° | 180.0° |
| C37 | C31 | C29 | C27 | 0.4° | 0.2° |
| C37 | C31 | C29 | N32 | 179.0° | 179.8° |
| C37 | C31 | C29 | O30 | 179.8° | 179.7° |
| C37 | C31 | N32 | C33 | 94.9° | 0.2° |
| C37 | C31 | N32 | H32 | 143.4° | 179.7° |
| F28 | C27 | C29 | C31 | 179.8° | 180.0° |
| F28 | C27 | C29 | O30 | 0.1° | 0.1° |
| F28 | C27 | C26 | H30 | 0.3° | 0.0° |
| C27 | C29 | C31 | O30 | 179.8° | 179.9° |
| C27 | C29 | C31 | N32 | 179.4° | 180.0° |
| C29 | C27 | C26 | H30 | 179.8° | 179.9° |
| C27 | C29 | O30 | H31 | 180.0° | 90.0° |
| C29 | C31 | N32 | C33 | 86.1° | 180.0° |
| C31 | C29 | O30 | H31 | 0.2° | 90.0° |
| C29 | C31 | N32 | H32 | 35.6° | 0.0° |
| C29 | C31 | C37 | H42 | 179.5° | 179.7° |
| N32 | C31 | C29 | O30 | 0.8° | 0.1° |
| C31 | N32 | C33 | H32 | 121.7° | 180.0° |
| C31 | N32 | C33 | C34 | 145.3° | 180.0° |
| C31 | N32 | C33 | H33 | 25.3° | 60.0° |
| C31 | N32 | C33 | H34 | 94.6° | 60.0° |
| N32 | C31 | C37 | H42 | 0.5° | 0.1° |
| N32 | C33 | C34 | C35 | 53.6° | 175.0° |
| N32 | C33 | C34 | H33 | 120.0° | 120.0° |
| N32 | C33 | C34 | H34 | 120.0° | 120.0° |
| N32 | C33 | C34 | C36 | 177.3° | 65.0° |
| N32 | C33 | H33 | H34 | 119.9° | 120.0° |
| N32 | C33 | C34 | H35 | 64.6° | 55.0° |
| C35 | C34 | C33 | C36 | 123.7° | 120.0° |
| C35 | C34 | C33 | H35 | 118.1° | 120.0° |
| C35 | C34 | C36 | H35 | 117.7° | 120.0° |
| C35 | C34 | C33 | H33 | 66.4° | 55.0° |
| C35 | C34 | C33 | H34 | 173.6° | 65.0° |
| C34 | C35 | H36 | H37 | 120.0° | 120.0° |
| C34 | C35 | H36 | H38 | 120.0° | 120.0° |
| C34 | C35 | H37 | H38 | 120.0° | 120.0° |
| C35 | C34 | C36 | H39 | 180.0° | 180.0° |
| C35 | C34 | C36 | H40 | 60.0° | 60.0° |
| C35 | C34 | C36 | H41 | 60.0° | 60.0° |
| C33 | C34 | C36 | H35 | 118.1° | 120.0° |
| C34 | C33 | N32 | H32 | 93.0° | 0.0° |
| C34 | C33 | H33 | H34 | 119.9° | 120.0° |
| C33 | C34 | C35 | H36 | 180.0° | 60.0° |
| C33 | C34 | C35 | H37 | 60.0° | 180.0° |
| C33 | C34 | C35 | H38 | 60.0° | 60.0° |
| C33 | C34 | C36 | H39 | 55.8° | 60.0° |
| C33 | C34 | C36 | H40 | 175.8° | 180.0° |
| C33 | C34 | C36 | H41 | 64.2° | 60.0° |
| C36 | C34 | C33 | H33 | 57.3° | 175.0° |
| C36 | C34 | C33 | H34 | 62.7° | 55.0° |
| C36 | C34 | C35 | H36 | 55.8° | 60.0° |
| C36 | C34 | C35 | H37 | 175.8° | 60.0° |
| C36 | C34 | C35 | H38 | 64.2° | 180.0° |
| C34 | C36 | H39 | H40 | 120.0° | 120.0° |
| C34 | C36 | H39 | H41 | 120.0° | 120.0° |
| C34 | C36 | H40 | H41 | 120.0° | 120.0° |
| H1 | C11 | C12 | H2 | 65.8° | 52.8° |
| H1 | C11 | C12 | H3 | 174.2° | 172.8° |
| H1 | C11 | C12 | H4 | 54.2° | 67.1° |
| H2 | C12 | H3 | H4 | 120.0° | 120.1° |
| H5 | C14 | C15 | H6 | 0.2° | 0.0° |
| H7 | C01 | H8 | H9 | 120.0° | 120.0° |
| H10 | C04 | C05 | H11 | 0.2° | 0.0° |
| H12 | C08 | C09 | H14 | 4.6° | 50.8° |
| H12 | C08 | C09 | H15 | 122.7° | 69.6° |
| H13 | C08 | C09 | H14 | 114.0° | 170.6° |
| H13 | C08 | C09 | H15 | 4.2° | 50.2° |
| H17 | C17 | C18 | H18 | 62.3° | 59.9° |
| H17 | C17 | C18 | H19 | 177.7° | 60.0° |
| H17 | C17 | C18 | H20 | 57.7° | 179.9° |
| H17 | C17 | C19 | H21 | 62.3° | 60.1° |
| H17 | C17 | C19 | H22 | 57.7° | 59.9° |
| H17 | C17 | C19 | H23 | 177.7° | 179.9° |
| H18 | C18 | H19 | H20 | 120.0° | 120.0° |
| H21 | C19 | H22 | H23 | 119.9° | 120.0° |
| H24 | C20 | C21 | H25 | 0.2° | 0.2° |
| H26 | C22 | C23 | H27 | 60.4° | 60.2° |
| H26 | C22 | C23 | H28 | 179.6° | 59.8° |
| H26 | C22 | C23 | H29 | 59.6° | 179.8° |
| H27 | C23 | H28 | H29 | 119.9° | 120.1° |
| H32 | N32 | C33 | H33 | 147.0° | 120.0° |
| H32 | N32 | C33 | H34 | 27.0° | 120.0° |
| H33 | C33 | C34 | H35 | 175.4° | 65.0° |
| H34 | C33 | C34 | H35 | 55.5° | 175.0° |
| H35 | C34 | C35 | H36 | 61.9° | 180.0° |
| H35 | C34 | C35 | H37 | 58.1° | 60.0° |
| H35 | C34 | C35 | H38 | 178.1° | 60.0° |
| H35 | C34 | C36 | H39 | 62.3° | 60.0° |
| H35 | C34 | C36 | H40 | 57.7° | 60.0° |
| H35 | C34 | C36 | H41 | 177.7° | 180.0° |
| H36 | C35 | H37 | H38 | 120.0° | 120.0° |
| H39 | C36 | H40 | H41 | 119.9° | 120.0° |
